24,25,40,43-Tetrahydroxy-26-(hydroxymethyl)-38-[[3-(hydroxymethyl)phenyl]methyl]-2-(3-hydroxypropyl)-27,29-dioxa-3,4-dithia-6,8-diazadecacyclo[28.10.2.124,28.01,36.05,14.07,12.011,22.013,17.018,22.034,42]tritetraconta-7(12),10,13,16,30,32,34(42),37,39-nonaene-35,41-dione

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 24,25,40,43-Tetrahydroxy-26-(hydroxymethyl)-38-[[3-(hydroxymethyl)phenyl]methyl]-2-(3-hydroxypropyl)-27,29-dioxa-3,4-dithia-6,8-diazadecacyclo[28.10.2.124,28.01,36.05,14.07,12.011,22.013,17.018,22.034,42]tritetraconta-7(12),10,13,16,30,32,34(42),37,39-nonaene-35,41-dione
• 英文别名: 24,25,40,43-tetrahydroxy-26-(hydroxymethyl)-38-[[3-(hydroxymethyl)phenyl]methyl]-2-(3-hydroxypropyl)-27,29-dioxa-3,4-dithia-6,8-diazadecacyclo[28.10.2.124,28.01,36.05,14.07,12.011,22.013,17.018,22.034,42]tritetraconta-7(12),10,13,16,30,32,34(42),37,39-nonaene-35,41-dione
• 化学式: C₄₉H₅₂N₂O₁₁S₂
• 分子量: 909.1
• InChiKey: DKUOELQFYVSMFI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  64
• 可旋转键数：
  7
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  269
• 氢给体数：
  9
• 氢受体数：
  15